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Search Results | ZINC Is Not Commercial - A database of commercially-available compounds
UCSF
ZINC Item Suppliers, Protomers, & Similar Substances

Analogs

5274022
5274022

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5R,8S,9S,10S,11R,12R,14R)-9-[(2S,4R,5R,6S)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl (2S,3S,4R,5R,8S,9S,10S,11R,12R,1…

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Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.17 1.18 -12.94 5 10 0 163 546.698 3 ↓

Analogs

5274022
5274022

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4R,5S,8S,9S,10S,11R,12R,14R)-9-[(2S,4R,5R,6S)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl (2S,3S,4R,5S,8S,9S,10S,11R,12R,1…

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Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.17 2.47 -18.46 5 10 0 163 546.698 3 ↓

Analogs

5274022
5274022

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4S,5R,8S,9S,10S,11R,12R,14R)-9-[(2S,4R,5R,6S)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl (2S,3S,4S,5R,8S,9S,10S,11R,12R,1…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.17 1.01 -15.67 5 10 0 163 546.698 3 ↓

Analogs

5274022
5274022

Draw Identity 99% 90% 80% 70%

Popular Name: (2S,3S,4S,5S,8S,9S,10S,11R,12R,14R)-9-[(2S,4R,5R,6S)-4,5-dihydroxy-4,6-dimethyl-tetrahydropyran-2-yl (2S,3S,4S,5S,8S,9S,10S,11R,12R,1…

Find On: PubMed — Wikipedia — Google

Activity (Go SEA)

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 2.17 1.03 -15.05 5 10 0 163 546.698 3 ↓

Parameters Provided:

ring.id = 231931
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

SELECT DISTINCT(ci.sub_id_fk) AS sub_id FROM catalog_item AS ci INNER JOIN catalog AS c ON ci.cat_id_fk=c.cat_id INNER JOIN hasring AS hr ON ci.sub_id_fk=hr.sub_id_fk INNER JOIN rings AS r ON hr.rings_fk=r.rings_id  WHERE r.rings_id = 231931 AND c.free = 1 AND c.purchasable = 0    LIMIT 50

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